COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK052094
Chemical Name: ethyl4-[2-(benzyloxy)phenyl]-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: CCOC(=O)C1=C(C)NC2=C(C1c1ccccc1OCc1ccccc1)C(=O)CCC2

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Molecular Weight: 417.5
Empirical Formula: C26H27NO4

Physical State: Dry powder
Available Amount: 288 mg

Lipinsky:
logP: 3.745
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 64
Number of rings: 4

     

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